data_image0 _chemical_formula_structural S8Ta12 _chemical_formula_sum "S8 Ta12" _cell_length_a 5.641175 _cell_length_b 7.520235 _cell_length_c 9.12624570464701 _cell_angle_alpha 90.0 _cell_angle_beta 108.00279222176985 _cell_angle_gamma 90.0 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy S S1 1.0 0.409267441 0.1722632338 0.0806354052 1.0000 S S2 1.0 0.9092678841 0.8277374311 0.0806354052 1.0000 S S3 1.0 0.9870968584999998 0.4159949789 0.23274087559999998 1.0000 S S4 1.0 0.48709818799999993 0.5840056859999999 0.23274087559999998 1.0000 S S5 1.0 0.2543570318000001 0.4159949789 0.7672593548 1.0000 S S6 1.0 0.754357475 0.5840056859999999 0.7672593548 1.0000 S S7 1.0 0.8286322253 0.1722632338 0.9193648252 1.0000 S S8 1.0 0.3286317822 0.8277374311 0.9193648252 1.0000 Ta Ta1 1.0 0.10135824989999999 0.1047121533 0.2152812198 1.0000 Ta Ta2 1.0 0.601358693 0.8952885116 0.2152812198 1.0000 Ta Ta3 1.0 0.6667244957 0.28108297149999995 0.3333026862 1.0000 Ta Ta4 1.0 0.1667258252 0.7189163637 0.3333026862 1.0000 Ta Ta5 1.0 0.4948693002999999 0.0053548859 0.5000001152 1.0000 Ta Ta6 1.0 0.2287935271 0.3441647768 0.5000001152 1.0000 Ta Ta7 1.0 0.7287939702 0.6558345584 0.5000001152 1.0000 Ta Ta8 1.0 0.9948697433999998 0.9946444493 0.5000001152 1.0000 Ta Ta9 1.0 0.8334219543 0.28108297149999995 0.6666975441999999 1.0000 Ta Ta10 1.0 0.3334232837999999 0.7189163637 0.6666975441999999 1.0000 Ta Ta11 1.0 0.3860771957 0.1047121533 0.7847190106 1.0000 Ta Ta12 1.0 0.8860776389 0.8952885116 0.7847190106 1.0000